3-methyl-2-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Chemical Structure Depiction of
3-methyl-2-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
3-methyl-2-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide
Compound characteristics
| Compound ID: | Y032-4191 |
| Compound Name: | 3-methyl-2-nitro-N-[5-(2-phenylpropyl)-1,3,4-thiadiazol-2-yl]benzamide |
| Molecular Weight: | 382.44 |
| Molecular Formula: | C19 H18 N4 O3 S |
| Smiles: | CC(Cc1nnc(NC(c2cccc(C)c2[N+]([O-])=O)=O)s1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1778 |
| logD: | 1.5587 |
| logSw: | -5.0473 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.878 |
| InChI Key: | SVBYPQCUPNXUMS-ZDUSSCGKSA-N |